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Substance Name: Parvaquone [INN:BAN]
RN: 4042-30-2
UNII: A2BH18685W
InChIKey: JBFUOGRCSLVENL-UHFFFAOYSA-N

Classification Codes

  • Anti-Infective Agents
  • Antimalarials
  • Antiparasitic Agents
  • Antiprotozoal Agents

Molecular Formula

  • C16-H16-O3

Molecular Weight

  • 256.299
 
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Names and Synonyms

Name of Substance

  • Parvaquone
  • Parvaquone [INN:BAN]

Synonyms

  • EINECS 223-734-5
  • NSC 278
  • Parvaquona
  • Parvaquona [Spanish]
  • Parvaquone
  • Parvaquonum
  • Parvaquonum [Latin]
  • UNII-A2BH18685W

Systematic Names

  • 1,4-Naphthalenedione, 2-cyclohexyl-3-hydroxy-
  • 2-Cyclohexyl-3-hydroxy-1,4-naphthoquinone
  • Parvaquone

Registry Numbers

CAS Registry Number

  • 4042-30-2

FDA UNII

  • A2BH18685W

System Generated Number

  • 0004042302

Structure Descriptors

InChI

1S/C16H16O3/c17-14-11-8-4-5-9-12(11)15(18)16(19)13(14)10-6-2-1-3-7-10/h4-5,8-10,19H,1-3,6-7H2

InChIKey

JBFUOGRCSLVENL-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)C(C(=C(C2=O)C1CCCCC1)O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 135.5 deg C   EXP
log P (octanol-water) 3.590 (none)   EST
Atmospheric OH Rate Constant 2.44E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.